CE 530 Molecular Simulation
Monte Carlo Integration: Review
Markov Processes
Transition-Probability Matrix
Distribution of State Occupancies
The Limiting Distribution 1.
The Limiting Distribution 2.
The Limiting Distribution 3.
Detailed Balance
Deriving Transition Probabilities
Metropolis Algorithm 1.
Metropolis Algorithm 2.
Markov Chains and Importance Sampling 1.
Markov Chains and Importance Sampling 2.
Markov Chains and Importance Sampling 3.
Evaluating Areas with Metropolis Sampling
Summary
Email: kofke@eng.buffalo.edu
Home Page: http://www.cheme.buffalo.edu/courses/ce530
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